Exact Mass: 458.2005604
Exact Mass Matches: 458.2005604
Found 500 metabolites which its exact mass value is equals to given mass value 458.2005604
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Deoxynivalenol 3-glucoside
Deoxynivalenol 3-glucoside is found in cereals and cereal products. Deoxynivalenol 3-glucoside is isolated from cultures of sweet corn (Zea mays). Isolated from cultures of sweet corn (Zea mays). Deoxynivalenol 3-glucoside is found in cereals and cereal products and fats and oils.
Austinol
Austinol is a metabolite of Emericella nidulans, Emericella dentata, Aspergillus variecolor and Aspergillus ustu Metabolite of Emericella nidulans, Emericella dentata, Aspergillus variecolor and Aspergillus ustus.
Gein
Sasanquin is found in fats and oils. Sasanquin is isolated from leaves of Camellia sasanqua and Camellia japonica. Isolated from roots of Geum urbanum (herb bennet)
3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside]
3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside] is found in herbs and spices. 3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside] is a constituent of rhizomes of Alpinia officinarum (lesser galangal). Constituent of rhizomes of Alpinia officinarum (lesser galangal). 3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside] is found in herbs and spices.
Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside]
Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside] is found in green vegetables. Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside] is a constituent of Rosa damascena (damask rose). Constituent of Rosa damascena (damask rose). Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside] is found in herbs and spices and green vegetables.
2-Hydroxy-desipramine glucuronide
2-Hydroxy-desipramine glucuronide is a metabolite of desipramine. Desipramine (also known as desmethylimipramine) is a tricyclic antidepressant (TCA). It inhibits the reuptake of norepinephrine and to a lesser extent serotonin. It is used to treat depression, but not considered a first line treatment since the introduction of SSRI antidepressants. Desipramine is an active metabolite of imipramine. It is sold under the brand names Norpramin and Pertofane. Along with other tricyclics, desipramine has found use in treating neuropathic pain. (Wikipedia)
2-Hydroxy-3-[(2-carboxyethyl)thio]-3-[2-(8-phenyloctyl)phenyl]propanoic acid
C26H34O5S (458.21268340000006)
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D020024 - Leukotriene Antagonists D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists
Advantame
Avitriptan
C22H30N6O3S (458.20999900000004)
C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist
Fluprostenol
Lexipafant
C23H30N4O4S (458.19876600000003)
Lignan
Lorglumide
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
7-[2,5-Dihydroxy-2-[3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoic acid
15(S)-Fluprostenol
2-methyl-5-(1-methylethyl)-phenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|carvacrol 2-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside
Benzyl glycoside,2-Ac-beta-Pyranose-3-O-alpha-L-Rhamnopyranosyl-D-galactose
8,9-Dihydro,8-hydroxy-Exiguaflavanone D|exiguaflavanone M
3,4,5,7-tetrahydroxy-6-[7-hydroxy-3,7-dimethyl-2(E)-octenyl]flavanone
8beta-<5-(4-hydroxytigloyl)-4-hydroxytigloyloxy>-kauniolide|8beta-[5-(4-hydroxytigloyl)-4-hydroxytigloyloxy]-kauniolide
8beta-<5-<4,5-dihydroxytigloyloxy>-tigloyloxy>-kauniolide|8beta-[5-(4,5-dihydroxytigloyloxy)-tigloyloxy]-kauniolide
rel-5-(3S,8S-dihydroxy-1R,5S-dimethyl-7-oxa-6-oxobicyclo[3,2,1]oct-8-yl)-3-methyl-2Z,4E-pentadienoic acid 3-O-beta-D-glucopyranoside
1-O-(6-O-alpha-L-rhamnopyranosyl-beta-D-glucopyranosyl)-2-hydroxy-4-allylbenzene|3,4-Dihydroxyallylbenzene 4-O-[??-L-rhamnopyranosyl-(1鈥樏傗垎6)]-??-D-glucopyranoside|demethyleugenol beta-rutinoside
Ligustrin-<5-O-(4-hydroxytigloyl)-4-hydroxy>-sarracinate|Ligustrin-[5-O-(4-hydroxytigloyl)-4-hydroxy]-sarracinate
(1R,2S,4S,5S,6R,7R,9S,10S)-1,9,15-triacetoxy-2,4,6-trihydroxy-8-oxodihydro-beta-agarofuran
(2E)-2-decene-4,6-diyne-1,8-diol 8-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside|(2E)-2-Decene-4,6-diyne-1,8-diol 8-O-??-D-apiofuranosyl-(1鈥樏傗垎6)-??-D-glucopyranoside
8beta-4-hydroxy-5-(tigloyloxy)-tigloyloxy-4beta,15-dihydro-3-dehydrozaluzanin C
desacetoxyzuubergenin-8beta-4-hydroxy-5-(5-hydroxysarracinoyl)-tiglate
5-Hydroxy-8-(4-methyl-3-pentenyl)-8-methyl-6-(2-methyl-1-oxopropyl)-4-phenyl-2H,8H-benzo[1,2-b:3,4-b]dipyran-2-one
(1alpha,4beta,8beta)-6-Chloro-1,4,8,15-tetrahydroxy-6-hirsuten-5-one|chloriolin B
C23H35ClO7 (458.20711900000003)
8beta-5-(5-hydroxytigloyloxy)-tigloyloxy-3-dehydro-4beta,15-dihydro-zaluzanin C|8beta-5-<5-hydroxytigloyloxy>-tigloyloxy-3-dehydro-4beta,15-dihydro-zaluzanin C
4-allyl-2-methoxyphenyl 6-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside|4-allyl-2-methoxyphenyl-O-beta-D-apiosyl-(1->6)-beta-D-glucopyranoside
1-[2,3-trans-3,4-dihydroxy-2-(1,4-dihydroxy-1,5-dimethylhex-5-enyl)-2,3-dihydrobenzofuran-5-yl]-3-(4-hydroxyphenyl)-E-propenone|xanthokeismin C
8beta,9alpha-diangeloyloxy-14-oic-acanthospermolide
4,6-decadiyne-1-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside
8beta,9alpha-diangeloyloxy-15-hydroxy-14-oxo-4,5-cis-acanthospermolide
4-Allyl-2-methoxyphenyl 6-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
4-methoxy-cinnamyl-(6-O-alpha-L-arabinopyranosyl)-O-beta-D-glucopyranoside|4-methoxycinnamyl 6-O-(alpha-L-arabinopyranosyl)-beta-D-glucopyranoside
11-hydroxykopsilongine|N-carbomethoxy-11-hydroxy-12-methoxy-kopsininaline
1-(beta-D-glucopyranosyloxybenzyl)-2-hydroxy-2-isopropyl-malate methyl ester
9-acetoxy-gamma-geraniol-(2,6-diacetyl-beta-D-glucopyranoside)
piperchabaoside A|trans-cinnamyl alcohol O-beta-D-glucopyranosyl-(1->4)-beta-D-glucopyranoside
Ligustrin-<4-hydroxy-5-(5-hydroxytigloyloxy)-tiglate>
1-(4-beta-D-glucopyranosyloxybenzyl)-(2R)-2-isobutylmalate|4-{{[(2R)-2-(carboxymethyl)-2-hydroxy-4-methyl-1-oxopentyl]oxy}methyl}phnyl beta-D-glucopyranoside|gymnoside I
4-(4-beta-D-glucopyranosyloxybenzyl)-(2R)-2-isobutylmalanate|4-{{[(3R)-3-carboxy-3-hydroxy-5-methyl-1-oxohexyl]oxy}methyl}phenyl beta-D- glucopyranoside|gymnoside II
His Thr Ser Asp
Kadsurin
Kadsurin, (-)- is a tannin. It has a role as a metabolite. Kadsurin is a natural product found in Kadsura coccinea, Kadsura heteroclita, and other organisms with data available.
Geoside
Geoside is a natural product found in Salacia chinensis, Rhodiola rosea, and other organisms with data available.
2-(hydroxymethyl)-6-[[3,4,5-trihydroxy-6-(4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
C25H30O8_3-Furancarboxylic acid, (3R,5S,5aS,6S,9aR)-octahydro-9-hydroxy-2,2,5a,9-tetramethyl-2H-3,9a-methano-1-benzoxepin-5,6-diyl ester
Deoxynivalenol 3-glucoside
D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1)
Ala His Met Thr
Ala His Thr Met
Ala Met His Thr
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Ala Thr His Met
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Cys His Ile Ser
Cys His Leu Ser
Cys His Ser Ile
Cys His Ser Leu
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Cys Ile His Ser
Cys Ile Ser His
Cys Leu His Ser
Cys Leu Ser His
Cys Ser His Ile
Cys Ser His Leu
Cys Ser Ile His
Cys Ser Leu His
Cys Thr His Val
Cys Thr Val His
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Asp Asp Ile Pro
Asp Asp Leu Pro
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Asp Glu Pro Val
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Glu Asp Pro Val
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Phe Gly His Val
Phe Gly Val His
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Gly Phe His Val
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Gly Gly Tyr Tyr
Gly His Phe Val
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His Ala Met Thr
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Ile Cys His Ser
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Leu Cys His Ser
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Leu Pro Asp Asp
Leu Ser Cys His
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Met Ala His Thr
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Asn Asp Asn Pro
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Asn Pro Gln Thr
Asn Pro Thr Gln
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Asn Gln Thr Pro
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Pro Asp Asp Ile
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Pro Pro Asp Met
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Pro Val Asp Glu
Pro Val Glu Asp
Gln Asn Pro Thr
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Ser Cys His Ile
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Val Asp Pro Glu
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Val Phe Gly His
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Val His Thr Cys
Val Pro Asp Glu
Val Pro Glu Asp
Val Thr Cys His
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Tyr Gly Gly Tyr
Tyr Gly Tyr Gly
Tyr Tyr Gly Gly
fluprostenol
D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D012102 - Reproductive Control Agents > D008186 - Luteolytic Agents C78568 - Prostaglandin Analogue
5-trans Fluprostenol
Austinol
A meroterpenoid produced by Aspergillus nidulans. It has a pentacyclic structure which incorporates three lactone functionalities and a spiro union.
3-Hydroxychavicol 1-[rhamnosyl-(1->6)-glucoside]
Eugenol O-[a-L-Arabinofuranosyl-(1->6)-b-D-glucopyranoside]
1,3-diisocyanato-2-methylbenzene,ethane-1,2-diol,hexanedioic acid,propane-1,2-diol
C20H30N2O10 (458.19003599999996)
Digalactosyldiacylglyceride Mixture
C18H34O13 (458.19993139999997)
(4R,5S)-2-[[(4R,5S)-4,5-diphenyl-4,5-dihydro-1,3-oxazol-2-yl]methyl]-4,5-diphenyl-4,5-dihydro-1,3-oxazole
4-[(2-Amino-1,3-benzothiazol-6-yl)amino]-6-methyl-7-[2-(1-piperid inyl)ethoxy]-3-quinolinecarbonitrile
C25H26N6OS (458.18887060000003)
4-((1H-INDAZOL-6-YL)AMINO)-6-METHOXY-7-(3-MORPHOLINOPROPOXY)QUINOLINE-3-CARBONITRILE
C25H26N6O3 (458.20662860000004)
ethyl 6-fluoro-1-(4-fluorophenyl)-7-[4-(2-hydroxyethyl)piperazin-1-yl]-4-oxo-1,8-naphthyridine-3-carboxylate
decanedioic acid,dimethyl benzene-1,4-dicarboxylate,ethane-1,2-diol
5-(diisopropylamino)-2-[[4-(dimethylamino)phenyl]azo]-3-methyl-1,3,4-thiadiazolium methyl sulphate
2-Ethoxy-1-[[2-[(hydroxyamino)iminomethyl][1,1-biphenyl]-4-yl]methyl]-1H-benzimidazole-7-carboxylic acid ethyl ester
C26H26N4O4 (458.19539560000004)
3-Pyridinecarbonitrile, 1,2-dihydro-6-hydroxy-4-methyl-1-3-(1-methylethoxy)propyl-2-oxo-5-4-(phenylazo)phenylazo-
C25H26N6O3 (458.20662860000004)
5-[(1R)-1-Hydroxy-2-[[(1R)-2-(4-methoxyphenyl)-1-methylethyl]amino]ethyl]-8-(phenylmethoxy)-2(1H)-quinolinone
2-C-(2,3,4,6-Tetra-O-benzyl-a-D-glucopyranosyl) ethyne
2-(1-((2-(1H-tetrazol-5-yl)-[1,1-biphenyl]-4-yl)Methyl)-2-butyl-4-Methyl-6-oxo-1,6-dihydropyriMidin-5-yl)acetic acid
C25H26N6O3 (458.20662860000004)
tributyl(5-hexylthiophen-2-yl)stannane
C22H42SSn (458.20290420000003)
(1R,3R,5S,6R)-8-Methyl-3-[(3,4,5-trimethoxybenzoyl)oxy]-8-azabicy clo[3.2.1]oct-6-yl 1-methyl-1H-pyrrole-2-carboxylate
4-(8-((4-((1S,4S)-5-Isopropyl-2,5-diazabicyclo(2.2.1)heptan-2-yl)phenyl)amino)-(1,2,4)triazolo(1,5-a)pyrazin-5-yl)furan-2-carboxamide
Ethyl 4-[[7-[(4-fluorophenyl)methyl]-1,3-dimethyl-2,6-dioxopurin-8-yl]methyl]piperazine-1-carboxylate
4-[2-(1,3-dioxo-2-benzo[de]isoquinolinyl)ethyl]-N-(4-methylphenyl)-1-piperazinecarbothioamide
4-[(diethylamino)sulfonyl]-N-[1-(4,5-dimethyl-6-oxo-1,6-dihydropyrimidin-2-yl)-3-methyl-1H-pyrazol-5-yl]benzamide
C21H26N6O4S (458.17361560000006)
Trimethylsilyl 3,4,5-tris[(trimethylsilyl)oxy]benzoate
(2s,4s,5r)-1-(4-Tert-Butylbenzoyl)-2-Isobutyl-5-(1,3-Thiazol-2-Yl)pyrrolidine-2,4-Dicarboxylic Acid
C24H30N2O5S (458.18753300000003)
(2S,3S)-2-amino-4-cyclopropyl-3-[(3R)-3-(2-fluoro-4-methylsulfonylphenyl)-1,2,4-oxadiazolidin-5-yl]-1-[(3S)-3-fluoropyrrolidin-1-yl]butan-1-one
2-(Hydroxymethyl)-6-[[3,4,5-trihydroxy-6-(4-prop-2-enylphenoxy)oxan-2-yl]methoxy]oxane-3,4,5-triol
(12R)-5-ethyl-12-(4-methoxyphenyl)-15,17-dimethyl-2,4,9,13-tetraoxatetracyclo[8.7.1.03,8.014,18]octadeca-1(17),14(18),15-triene-6,7,16-triol
2-Hydroxy-desipramine glucuronide
2-Hydroxy-desipramine glucuronide is a metabolite of desipramine. Desipramine (also known as desmethylimipramine) is a tricyclic antidepressant (TCA). It inhibits the reuptake of norepinephrine and to a lesser extent serotonin. It is used to treat depression, but not considered a first line treatment since the introduction of SSRI antidepressants. Desipramine is an active metabolite of imipramine. It is sold under the brand names Norpramin and Pertofane. Along with other tricyclics, desipramine has found use in treating neuropathic pain. (Wikipedia)
O-methyl-4-O-[alpha-L-rhamnopyranosyl-(1->3)-2-O-methyl-alpha-L-rhamnopyranosyl]-hydroxybenzoate
2-amino-N-[5-[(6-dimethylamino-9H-purin-9-yl)]-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]-3-(4-hydroxyphenyl)-propanamid
C21H28N7O5+ (458.21518180000004)
7-[2,5-Dihydroxy-2-[3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoic acid
O-demethylpuromycin(1+)
C21H28N7O5+ (458.21518180000004)
The conjugate acid of O-demethylpuromycin; major species at pH 7.3.
3-[(2-methoxyphenyl)methyl]-5-[1-[(4-methylphenyl)-oxomethyl]-4-piperidinyl]-2H-triazolo[4,5-d]pyrimidin-7-one
C25H26N6O3 (458.20662860000004)
2-[[4-(4-methoxyphenyl)-5-(2-phenylethyl)-1,2,4-triazol-3-yl]thio]-N-(phenylmethyl)acetamide
1-[(6,7-dimethoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(phenylmethyl)-1-(3-pyridinylmethyl)urea
C26H26N4O4 (458.19539560000004)
2-[3-[(Z)-(3-cyclopentyl-4-oxo-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]-2-methylindol-1-yl]acetamide
(E)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(3R)-3-hydroxy-4-[3-(trifluoromethyl)phenoxy]but-1-enyl]cyclopentyl]hept-5-enoic acid
N-[(2S,3R,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2S,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2R,3R,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
2-[(1S,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(1S,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxyacetyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b][1]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(3R,6aR,8R,10aR)-3-hydroxy-1-(pyrazine-2-carbonyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-fluorophenyl)methyl]acetamide
N-[(2R,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2R,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2R,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)oxan-3-yl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
N-[(2S,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
2-[(1R,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(3R,6aS,8S,10aS)-3-hydroxy-1-(pyrazine-2-carbonyl)-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-fluorophenyl)methyl]acetamide
2-[(3S,6aR,8S,10aR)-3-hydroxy-1-[oxo(2-pyrazinyl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-fluorophenyl)methyl]acetamide
2-[(3S,6aR,8R,10aR)-3-hydroxy-1-[oxo(2-pyrazinyl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-fluorophenyl)methyl]acetamide
2-[(3S,6aS,8S,10aS)-3-hydroxy-1-[oxo(2-pyrazinyl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-fluorophenyl)methyl]acetamide
N-[(2S,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-4-methylbenzenesulfonamide
C24H30N2O5S (458.18753300000003)
2-[(3S,6aS,8R,10aS)-3-hydroxy-1-[oxo(2-pyrazinyl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-fluorophenyl)methyl]acetamide
2-[(3R,6aS,8R,10aS)-3-hydroxy-1-[oxo(2-pyrazinyl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-fluorophenyl)methyl]acetamide
(6R,7S,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7S,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7R,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
2-[(1S,3S,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(1R,3S,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(1R,3R,4aS,9aR)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(1S,3R,4aR,9aS)-1-(hydroxymethyl)-6-[(2-methoxy-1-oxoethyl)amino]-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N-[(2-fluorophenyl)methyl]acetamide
2-[(3R,6aR,8S,10aR)-3-hydroxy-1-[oxo(2-pyrazinyl)methyl]-3,4,6,6a,8,9,10,10a-octahydro-2H-pyrano[2,3-c][1,5]oxazocin-8-yl]-N-[(4-fluorophenyl)methyl]acetamide
[(3aS,4R,9bS)-4-(hydroxymethyl)-8-(2-methoxyphenyl)-2,3,3a,4,5,9b-hexahydropyrrolo[3,2-c]quinolin-1-yl]-(1,3-benzodioxol-5-yl)methanone
C27H26N2O5 (458.18416260000004)
(6R,7R,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7R,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6S,7S,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6R,7R,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(6R,7S,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(2E)-2-[(2-fluorophenyl)methylidene]-4-[2-oxo-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-1,4-benzoxazin-3-one
C26H23FN4O3 (458.17540999999994)
Trimethylsilyl 2,4,6-tris[(trimethylsilyl)oxy]benzoate
(1-phosphonooxy-3-propanoyloxypropan-2-yl) (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate
lorglumide
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
Avitriptan
C22H30N6O3S (458.20999900000004)
C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist
2-(2-Methoxy-4-prop-2-enylphenoxy)-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxane-3,4,5-triol
Camlipixant
Camlipixant (BLU-5937) a potent, selective, non-competitive and orally active P2X3 homotrimeric receptor antagonist with an IC50 of 25 nM against hP2X3 homotrimeric. Camlipixant shows potent anti-tussive effect and no taste alteration. Camlipixant can be used for the research of unexplained, refractory chronic cough[1].
FABPs ligand 6
FABPs ligand 6 (MF6) is an FABP5 and FABP7 inhibitor with KD values of 874 nM and 20 nM, respectively. FABPs ligand 6 can be used for multiple sclerosis research[1].
(1's,2s,3'r,4'r,10's,15'r)-3'-ethyl-12'-hydroxy-4'-methoxy-4-methyl-15'-[(2r,4r)-4-methyl-5-oxooxolan-2-yl]-13'-oxa-9',11'-diazaspiro[furan-2,2'-tetracyclo[7.4.2.0¹,¹⁰.0⁴,¹⁰]pentadecane]-5',11'-dien-5-one
5-ethenyl-1-oxo-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,4ah,5h,6h-pyrano[3,4-c]pyran-3-yl 2-methylbutanoate
[(3ar,4s,6as,9ar,9br)-4-[(4-hydroxy-2-methylidenebutanoyl)oxy]-3,6-dimethylidene-2-oxo-3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-9-yl]methyl (2z)-4-hydroxy-2-methylbut-2-enoate
7-hydroxy-9,14-dimethyl-8-[(2-methylbut-2-enoyl)oxy]-5-methylidene-4-oxo-3,13-dioxatetracyclo[8.4.0.0²,⁶.0¹²,¹⁴]tetradec-9-en-11-yl 2-methylbut-2-enoate
2-hydroxy-4-[2-hydroxy-4-methoxy-6-(2-oxononyl)benzoyloxy]-6-methylbenzoic acid
2,9,18-trimethyl (1r,9s,15s,16r,18r)-15-hydroxy-2,12-diazapentacyclo[14.2.2.0¹,⁹.0³,⁸.0¹²,¹⁶]icosa-3,5,7-triene-2,9,18-tricarboxylate
3-hydroxy-5-methyl-3-{[(4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methoxy]carbonyl}hexanoic acid
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[(10-hydroxydec-8-en-4,6-diyn-3-yl)oxy]oxane-3,4,5-triol
(3s,4as,5r,6s)-5-ethenyl-1-oxo-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,4ah,5h,6h-pyrano[3,4-c]pyran-3-yl (2s)-2-methylbutanoate
4a,8-dimethyl-9-[(2-methylbut-2-enoyl)oxy]-3-methylidene-2,5-dioxo-3ah,4h,7ah,8h,9h,9ah-azuleno[6,5-b]furan-4-yl 2-(hydroxymethyl)but-2-enoate
2,18-dimethyl (1s,9r,16s,17s,18r,21r)-17,18-dihydroxy-6-methoxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7-triene-2,18-dicarboxylate
(2e)-3-{[(3ar,4r,6ar,9s,9ar,9br)-9-methyl-3,6-dimethylidene-2,8-dioxo-octahydroazuleno[4,5-b]furan-4-yl]oxy}-2-ethylidene-3-oxopropyl (2e)-2-(hydroxymethyl)but-2-enoate
(2s,3r,4s,5s,6r)-2-[2-methoxy-4-(prop-2-en-1-yl)phenoxy]-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
5-hydroxy-8-methyl-8-(4-methylpent-3-en-1-yl)-6-(2-methylpropanoyl)-4-phenylpyrano[2,3-f]chromen-2-one
n-[(11s,17s)-10-hydroxy-2,16-dioxo-1,9,15-triazapentacyclo[17.6.1.0³,⁸.0¹¹,¹⁵.0²⁰,²⁵]hexacosa-3,5,7,9,19(26),20,22,24-octaen-17-yl]-n-methylacetamide
C26H26N4O4 (458.19539560000004)
3'-ethyl-12'-hydroxy-4'-methoxy-4-methyl-15'-(4-methyl-5-oxooxolan-2-yl)-13'-oxa-9',11'-diazaspiro[furan-2,2'-tetracyclo[7.4.2.0¹,¹⁰.0⁴,¹⁰]pentadecane]-5',11'-dien-5-one
(1r,2s,12s,14r,15r,17s)-2,6,6,11,14,17-hexamethyl-8,18,19-trioxo-7,16,20-trioxapentacyclo[13.3.3.0¹,¹⁵.0²,¹².0⁵,¹⁰]henicosa-4,10-diene-14-carboxylic acid
(8r)-5-hydroxy-8-methyl-8-(4-methylpent-3-en-1-yl)-6-(2-methylpropanoyl)-4-phenylpyrano[2,3-f]chromen-2-one
(3ar,4s,6ar,8s,9ar,9br)-8-{[(2e)-4-hydroxy-2-methylbut-2-enoyl]oxy}-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl (2e)-4-hydroxy-2-methylbut-2-enoate
(2z,6e)-2-[(3r)-3-chloro-4-methylpent-4-en-1-yl]-9-[(2r)-6-hydroxy-2,8-dimethylchromen-2-yl]-6-methylnona-2,6-dienoic acid
C27H35ClO4 (458.22237400000006)